dichlorozinc;hydrate;trihydrochloride

H5Cl5OZn — CID 174468623

IUPACdichlorozinc;hydrate;trihydrochloride
SMILESCl.Cl.Cl.Cl[Zn]Cl.O
InChIInChI=1S/5ClH.H2O.Zn/h5*1H;1H2;/q;;;;;;+2/p-2
InChIKeyBYJBLKWUVQOWJX-UHFFFAOYSA-L
MW263.69 g/mol
LogP1.82
Rot. Bonds

About dichlorozinc;hydrate;trihydrochloride

dichlorozinc;hydrate;trihydrochloride (PubChem CID 174468623) has the molecular formula H5Cl5OZn and a molecular weight of 263.69 g/mol. Its IUPAC name is dichlorozinc;hydrate;trihydrochloride.

Molecular Properties

Compound Namedichlorozinc;hydrate;trihydrochloride
PubChem CID174468623
Molecular FormulaH5Cl5OZn
Molecular Weight263.69 g/mol
Exact Mass259.81
IUPAC Namedichlorozinc;hydrate;trihydrochloride
SMILESCl.Cl.Cl.Cl[Zn]Cl.O
InChIInChI=1S/5ClH.H2O.Zn/h5*1H;1H2;/q;;;;;;+2/p-2
InChIKeyBYJBLKWUVQOWJX-UHFFFAOYSA-L
XLogP1.82
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.69
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dichlorozinc;hydrate;trihydrochloride?
The IUPAC name of dichlorozinc;hydrate;trihydrochloride (CID 174468623) is dichlorozinc;hydrate;trihydrochloride.
What is the SMILES notation for dichlorozinc;hydrate;trihydrochloride?
The canonical SMILES for dichlorozinc;hydrate;trihydrochloride is Cl.Cl.Cl.Cl[Zn]Cl.O.
What is the InChIKey of dichlorozinc;hydrate;trihydrochloride?
The InChIKey is BYJBLKWUVQOWJX-UHFFFAOYSA-L. The full InChI is InChI=1S/5ClH.H2O.Zn/h5*1H;1H2;/q;;;;;;+2/p-2.
What are the key properties of dichlorozinc;hydrate;trihydrochloride?
dichlorozinc;hydrate;trihydrochloride has a molecular weight of 263.69 g/mol, XLogP of 1.82, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorozinc;hydrate;trihydrochloride is sourced from PubChem (CID 174468623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).